COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.044   1.180   1.672  1.00  0.00           C  
HETATM    2  C   UNL     1       2.818   2.156  -1.699  1.00  0.00           C  
HETATM    3  C   UNL     1       4.270  -0.147   1.472  1.00  0.00           C  
HETATM    4  C   UNL     1       2.592   3.483  -1.500  1.00  0.00           C  
HETATM    5  C   UNL     1       3.552  -0.006  -0.811  1.00  0.00           C  
HETATM    6  C   UNL     1       3.311   3.342   0.784  1.00  0.00           C  
HETATM    7  C   UNL     1       3.306   1.368  -0.643  1.00  0.00           C  
HETATM    8  C   UNL     1       3.556   1.969   0.616  1.00  0.00           C  
HETATM    9  C   UNL     1       4.025  -0.738   0.234  1.00  0.00           C  
HETATM   10  C   UNL     1       2.838   4.076  -0.262  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.638  -1.799   1.530  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.833  -2.025   0.199  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.094  -0.575   1.934  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.797   0.386   1.019  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.505  -1.018  -0.720  1.00  0.00           C  
HETATM   16  C   UNL     1       0.873  -2.005   0.209  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.565  -0.001  -0.201  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.419  -4.104  -1.102  1.00  0.00           C  
HETATM   19  C   UNL     1       0.956  -4.387  -0.487  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.473   2.814   0.591  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.229  -3.254  -0.121  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.616   1.426   1.493  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.990   1.260  -1.290  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.628   2.073  -0.950  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.138   1.648   1.524  1.00  0.00           C  
HETATM   26  C   UNL     1       1.732  -3.070  -0.410  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.109   2.410  -0.838  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.178  -0.964   0.892  1.00  0.00           C  
HETATM   29  N   UNL     1      -5.074   0.194  -0.291  1.00  0.00           N  
HETATM   30  N   UNL     1      -0.454  -2.097   0.310  1.00  0.00           N  
HETATM   31  N   UNL     1      -2.244   1.123   0.102  1.00  0.00           N  
HETATM   32  N   UNL     1       2.934  -3.259   0.405  1.00  0.00           N  
HETATM   33  O   UNL     1      -5.608  -1.234  -1.917  1.00  0.00           O  
HETATM   34  O   UNL     1       1.414  -1.012   0.645  1.00  0.00           O  
HETATM   35  O   UNL     1      -1.265  -0.237  -1.352  1.00  0.00           O  
HETATM   36  O   UNL     1       4.537  -2.660  -1.374  1.00  0.00           O  
HETATM   37  O   UNL     1       5.288  -2.823   1.004  1.00  0.00           O  
HETATM   38  S   UNL     1       4.332  -2.460   0.018  1.00  0.00           S  
HETATM   39 CL   UNL     1       2.537   5.772  -0.050  1.00  0.00          Cl  
HETATM   40  H   UNL     1       4.235   1.624   2.638  1.00  0.00           H  
HETATM   41  H   UNL     1       2.624   1.711  -2.664  1.00  0.00           H  
HETATM   42  H   UNL     1       4.645  -0.751   2.285  1.00  0.00           H  
HETATM   43  H   UNL     1       2.218   4.087  -2.314  1.00  0.00           H  
HETATM   44  H   UNL     1       3.366  -0.478  -1.765  1.00  0.00           H  
HETATM   45  H   UNL     1       3.496   3.814   1.738  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.902  -2.550   2.259  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.235  -2.968  -0.143  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.910  -0.391   2.983  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.296  -3.563  -2.040  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.938  -5.045  -1.285  1.00  0.00           H  
HETATM   51  H   UNL     1       0.833  -4.799   0.515  1.00  0.00           H  
HETATM   52  H   UNL     1       1.499  -5.097  -1.111  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.539   3.036   0.649  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.899   3.694   0.881  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.142  -2.914  -0.609  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.490  -3.857   0.748  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.103   2.329   1.826  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.350   0.589   2.138  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.993   1.639  -1.486  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.585   0.846  -2.214  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.431   1.630  -1.926  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.042   2.985  -0.844  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.476   1.869   2.536  1.00  0.00           H  
HETATM   64  H   UNL     1       2.023  -2.762  -1.415  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.302   3.261  -1.490  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.539  -0.457   1.614  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.077  -1.326   1.392  1.00  0.00           H  
HETATM   68  H   UNL     1       2.912  -3.853   1.171  1.00  0.00           H  
CONECT    1    3    3    8   40                                       
CONECT    2    4    4    7   41                                       
CONECT    3    1    1    9   42                                       
CONECT    4    2    2   10   43                                       
CONECT    5    7    9    9   44                                       
CONECT    6    8   10   10   45                                       
CONECT    7    2    5    8    8                                       
CONECT    8    1    6    7    7                                       
CONECT    9    3    5    5   38                                       
CONECT   10    4    6    6   39                                       
CONECT   11   12   12   13   46                                       
CONECT   12   11   11   15   47                                       
CONECT   13   11   14   14   48                                       
CONECT   14   13   13   25   29                                       
CONECT   15   12   29   33   33                                       
CONECT   16   26   30   34   34                                       
CONECT   17   28   31   35   35                                       
CONECT   18   19   21   49   50                                       
CONECT   19   18   26   51   52                                       
CONECT   20   25   27   53   54                                       
CONECT   21   18   30   55   56                                       
CONECT   22   25   31   57   58                                       
CONECT   23   27   29   59   60                                       
CONECT   24   27   31   61   62                                       
CONECT   25   14   20   22   63                                       
CONECT   26   16   19   32   64                                       
CONECT   27   20   23   24   65                                       
CONECT   28   17   30   66   67                                       
CONECT   29   14   15   23                                            
CONECT   30   16   21   28                                            
CONECT   31   17   22   24                                            
CONECT   32   26   38   68                                            
CONECT   33   15   15                                                 
CONECT   34   16   16                                                 
CONECT   35   17   17                                                 
CONECT   36   38   38                                                 
CONECT   37   38   38                                                 
CONECT   38    9   32   36   36                                       
CONECT   38   37   37                                                 
CONECT   39   10                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   19                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   22                                                      
CONECT   58   22                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   25                                                      
CONECT   64   26                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   32                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
